Geometry & MOs

Info

ID:	282674
PubChem CID:	103935699
Reduced:	NO2C16H23 (1)
Stoich.:	AB2C16D23 (1)
Weight, g/mol:	267.183444
ΔH_f, kcal/mol:	-75.02
Dipole, Da:	2.25
IP(EA), eV:	-8.85(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethyl-2-[1-(2-methoxyphenyl)propan-2-ylamino]propane-1,3-diol

Drug info:

PubChemData

Smile

C1CC(CN(C1)CCC(=O)C2=CC=CC=C2)CCO

DOS

IR

Vibrations